CHEMBL516088


SMILES COc1c(OCCF)cccc1C(=O)C1CCN(CCc2ccc(F)cc2)CC1
InChIKey HVJOIRMQZXEGPW-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 4
Hydrogen bond donors 0
Rotatable bonds 9
Molecular weight (Da) 403.2

Drug properties

Molecular type Small molecule
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
5-HT5A 5HT5A Human 5-Hydroxytryptamine A pKi 5.8 5.8 5.8 ChEMBL
D5 DRD5 Human Dopamine A pKi 5.13 5.13 5.13 ChEMBL
5-HT1B 5HT1B Human 5-Hydroxytryptamine A pKi 5.66 5.66 5.66 ChEMBL
5-HT1D 5HT1D Human 5-Hydroxytryptamine A pKi 6.15 6.15 6.15 ChEMBL
α1B ADA1B Human Adrenoceptors A pKi 6.26 6.26 6.26 ChEMBL
α2C ADA2C Human Adrenoceptors A pKi 6.48 6.48 6.48 ChEMBL
H2 HRH2 Human Histamine A pKi 5.75 5.75 5.75 ChEMBL
5-HT7 5HT7R Human 5-Hydroxytryptamine A pKi 6.68 6.68 6.68 ChEMBL
D4 DRD4 Human Dopamine A pKi 6.76 6.76 6.76 ChEMBL
α1A ADA1A Human Adrenoceptors A pKi 6.84 6.84 6.84 ChEMBL
α2A ADA2A Human Adrenoceptors A pKi 6.06 6.06 6.06 ChEMBL
D1 DRD1 Human Dopamine A pKi 5.85 5.85 5.85 ChEMBL
5-HT2B 5HT2B Human 5-Hydroxytryptamine A pKi 6.02 6.02 6.02 ChEMBL
5-HT2C 5HT2C Human 5-Hydroxytryptamine A pKi 6.89 6.89 6.89 ChEMBL
5-HT1A 5HT1A Human 5-Hydroxytryptamine A pKi 5.77 5.77 5.77 ChEMBL
D2 DRD2 Human Dopamine A pKi 5.42 5.42 5.42 ChEMBL
H1 HRH1 Human Histamine A pKi 6.03 6.03 6.03 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database